V003-6221 Screening compound: N-butyl-1-(4-chlorobenzoyl)-4-(2-methoxyphenyl)pyrrolidine-3-carboxamide

V003-6221 Screening compound: N-butyl-1-(4-chlorobenzoyl)-4-(2-methoxyphenyl)pyrrolidine-3-carboxamide
V003-6221 Screening compound: N-butyl-1-(4-chlorobenzoyl)-4-(2-methoxyphenyl)pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-6221
N-butyl-1-(4-chlorobenzoyl)-4-(2-methoxyphenyl)pyrrolidine-3-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V003-6221

Molecular Formula

C23H27ClN2O3 (C23 H27 ClN2 O3)

Compound Name

N-butyl-1-(4-chlorobenzoyl)-4-(2-methoxyphenyl)pyrrolidine-3-carboxamide

IUPAC name

N-butyl-1-(4-chlorobenzoyl)-4-(2-methoxyphenyl)pyrrolidine-3-carboxamide

SMILES

CCCCNC(C(CN(C1)C(c(cc2)ccc2Cl)=O)C1c(cccc1)c1OC)=O

InChI

InChI=1S/C23H27ClN2O3/c1-3-4-13-25-22(27)20-15-26(23(28)16-9-11-17(24)12-10-16)14-19(20)18-7-5-6-8-21(18)29-2/h5-12,19-20H,3-4,13-15H2,1-2H3,(H,25,27)

InChI Key

FVFYRRCGPFCKIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14261525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.93

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.231

Distribution Coefficient, logD

4.231

Water Solubility, LogSw

-4.63

Polar Surface Area

49.005

Acid Dissociation Constant (pKa)

13.73

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.10

V003-6221 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V003-6221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-6221?
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What is the minimum amount of V003-6221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-6221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-6221
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V003-6221 available by request